butyl 4-[[2-[(2-methoxyphenyl)carbamoylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-[(2-methoxyphenyl)carbamoylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 4-[[2-[(2-methoxyphenyl)carbamoylamino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[[(2-methoxyanilino)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(2-methoxyphenyl)carbamoylamino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(2-methoxyphenyl)carbamoylamino]-3-phenyl-propanoyl]amino]benzoic acid butyl ester Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C28H31N3O5/c1-3-4-18-36-27(33)21-14-16-22(17-15-21)29-26(32)24(19-20-10-6-5-7-11-20)31-28(34)30-23-12-8-9-13-25(23)35-2/h5-17,24H,3-4,18-19H2,1-2H3,(H,29,32)(H2,30,31,34)